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Reference substances

Reference substances

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IUPAC name:
1,1'-[(5-{6-[({[(E)-(butan-2-ylidene)amino]oxy}carbonyl)amino]hexyl}-2,4,6-trioxo-1,3,5-triazinane-1,3-diyl)di(hexane-6,1-diyl)]bis(3,5-bis{6-[({[(E)-(butan-2-ylidene)amino]oxy}carbonyl)amino]hexyl}-1,3,5-triazinane-2,4,6-trione)

Inventory

Synonyms

Molecular and structural information

Molecular formula:
C76H129N19O19
Molecular weight:
1 612.95
SMILES notation:
O=C3N(CCCCCCNC(=O)O\N=C(/C)CC)C(=O)N(CCCCCCN2C(=O)N(CCCCCCNC(=O)O\N=C(/C)CC)C(=O)N(CCCCCCN1C(=O)N(CCCCCCNC(=O)O\N=C(/C)CC)C(=O)N(CCCCCCNC(=O)O\N=C(/C)CC)C1=O)C2=O)C(=O)N3CCCCCCNC(=O)O\N=C(/C)CC
InChl:
InChI=1S/C76H129N19O19/c1-11-58(6)82-110-63(96)77-44-30-16-21-35-49-87-68(101)88(50-36-22-17-31-45-78-64(97)111-83-59(7)12-2)71(104)92(70(87)103)54-40-26-28-42-56-94-74(107)91(53-39-25-20-34-48-81-67(100)114-86-62(10)15-5)75(108)95(76(94)109)57-43-29-27-41-55-93-72(105)89(51-37-23-18-32-46-79-65(98)112-84-60(8)13-3)69(102)90(73(93)106)52-38-24-19-33-47-80-66(99)113-85-61(9)14-4/h11-57H2,1-10H3,(H,77,96)(H,78,97)(H,79,98)(H,80,99)(H,81,100)
Structural formula:
Chemical structure

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